N-[4-[4-(methoxymethyl)phenyl]phenyl]-2-(2-methoxyphenoxy)-2-methylpropanamide

C25H27NO4 — CID 164531759

IUPACN-[4-[4-(methoxymethyl)phenyl]phenyl]-2-(2-methoxyphenoxy)-2-methylpropanamide
SMILESCOCc1ccc(-c2ccc(NC(=O)C(C)(C)Oc3ccccc3OC)cc2)cc1
InChIInChI=1S/C25H27NO4/c1-25(2,30-23-8-6-5-7-22(23)29-4)24(27)26-21-15-13-20(14-16-21)19-11-9-18(10-12-19)17-28-3/h5-16H,17H2,1-4H3,(H,26,27)
InChIKeyPAXCEATZMBWZBV-UHFFFAOYSA-N
MW405.49 g/mol
LogP5.30
Rot. Bonds8

About N-[4-[4-(methoxymethyl)phenyl]phenyl]-2-(2-methoxyphenoxy)-2-methylpropanamide

N-[4-[4-(methoxymethyl)phenyl]phenyl]-2-(2-methoxyphenoxy)-2-methylpropanamide (PubChem CID 164531759) has the molecular formula C25H27NO4 and a molecular weight of 405.49 g/mol. Its IUPAC name is N-[4-[4-(methoxymethyl)phenyl]phenyl]-2-(2-methoxyphenoxy)-2-methylpropanamide.

Molecular Properties

Compound NameN-[4-[4-(methoxymethyl)phenyl]phenyl]-2-(2-methoxyphenoxy)-2-methylpropanamide
PubChem CID164531759
Molecular FormulaC25H27NO4
Molecular Weight405.49 g/mol
Exact Mass405.19
IUPAC NameN-[4-[4-(methoxymethyl)phenyl]phenyl]-2-(2-methoxyphenoxy)-2-methylpropanamide
SMILESCOCc1ccc(-c2ccc(NC(=O)C(C)(C)Oc3ccccc3OC)cc2)cc1
InChIInChI=1S/C25H27NO4/c1-25(2,30-23-8-6-5-7-22(23)29-4)24(27)26-21-15-13-20(14-16-21)19-11-9-18(10-12-19)17-28-3/h5-16H,17H2,1-4H3,(H,26,27)
InChIKeyPAXCEATZMBWZBV-UHFFFAOYSA-N
XLogP5.30
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500405.49
LogP ≤ 55.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-N-[4-(2-methoxyphenoxy)phenyl]-2-methylpropanamide
CID 131944896
2-(2-methoxyphenoxy)-2-methyl-N-[4-(1-methylpiperidin-4-yl)oxyphenyl]propanamide
CID 131915345
2-methoxy-N-[4-[4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide
CID 3299583
1-(methoxymethyl)-4-phenylbenzene
CID 14906855
N-[(3,4-dimethoxyphenyl)methyl]-N'-(4-fluorophenyl)-2,2-dimethylpropanediamide
CID 108965127
benzyl N-[4-(4-methoxy-5-oxocyclohepta-1,3,6-trien-1-yl)phenyl]carbamate
CID 22403841
N-[4-(4-ethoxyphenyl)phenyl]-2-(4-fluorophenoxy)-2-methylpropanamide
CID 164531783
3-(3,4-dimethoxyphenyl)-N-(4-phenylphenyl)propanamide
CID 8880797
formaldehyde;1-(methoxymethyl)-4-phenylbenzene
CID 168878800
1-(4-ethylphenyl)-3-[(2-methoxyphenoxy)methyl]urea
CID 108892216
N-(4-bromophenyl)-2-methyl-2-phenoxypropanamide
CID 11858792
2-(4-fluorophenoxy)-N-[4-(2-hydroxyethyl)phenyl]-2-methylpropanamide
CID 110902168

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-(methoxymethyl)phenyl]phenyl]-2-(2-methoxyphenoxy)-2-methylpropanamide?
The IUPAC name of N-[4-[4-(methoxymethyl)phenyl]phenyl]-2-(2-methoxyphenoxy)-2-methylpropanamide (CID 164531759) is N-[4-[4-(methoxymethyl)phenyl]phenyl]-2-(2-methoxyphenoxy)-2-methylpropanamide.
What is the SMILES notation for N-[4-[4-(methoxymethyl)phenyl]phenyl]-2-(2-methoxyphenoxy)-2-methylpropanamide?
The canonical SMILES for N-[4-[4-(methoxymethyl)phenyl]phenyl]-2-(2-methoxyphenoxy)-2-methylpropanamide is COCc1ccc(-c2ccc(NC(=O)C(C)(C)Oc3ccccc3OC)cc2)cc1.
What is the InChIKey of N-[4-[4-(methoxymethyl)phenyl]phenyl]-2-(2-methoxyphenoxy)-2-methylpropanamide?
The InChIKey is PAXCEATZMBWZBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27NO4/c1-25(2,30-23-8-6-5-7-22(23)29-4)24(27)26-21-15-13-20(14-16-21)19-11-9-18(10-12-19)17-28-3/h5-16H,17H2,1-4H3,(H,26,27).
What are the key properties of N-[4-[4-(methoxymethyl)phenyl]phenyl]-2-(2-methoxyphenoxy)-2-methylpropanamide?
N-[4-[4-(methoxymethyl)phenyl]phenyl]-2-(2-methoxyphenoxy)-2-methylpropanamide has a molecular weight of 405.49 g/mol, XLogP of 5.30, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-(methoxymethyl)phenyl]phenyl]-2-(2-methoxyphenoxy)-2-methylpropanamide is sourced from PubChem (CID 164531759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).